{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.026773 2.5022 1.482523 ] [ 1.327692 1.758529 3.84576 ] [ 1.586091 4.007002 3.406328 ] [ 4.160839 1.404559 1.89873 ] [ 3.792152 2.753975 4.110825 ] [ 3.943377 3.908391 2.363825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026773e-10 2.5022e-10 1.482523e-10 ] [ 1.327692e-10 1.758529e-10 3.84576e-10 ] [ 1.586091e-10 4.007002e-10 3.406328e-10 ] [ 4.160839e-10 1.404559e-10 1.89873e-10 ] [ 3.792152e-10 2.753975e-10 4.110825e-10 ] [ 3.943377e-10 3.908391e-10 2.363825e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2287069 -0.3821768 -7.5573479 ] [ -1.7721284 -16.2780257 5.8101486 ] [ -1.9034587 20.4751295 -1.378896 ] [ 4.834938 -5.0947203 -1.0764269 ] [ -1.6944851 -36.2489155 55.5201767 ] [ 4.7638412 37.528709 -51.3176544 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.775135331395644e-09 -6.123147339721574e-10 -1.210820612063198e-08 ] [ -2.839262691535711e-09 -2.608027220932155e-08 9.308884250293852e-09 ] [ -3.049677027798361e-09 3.280477379275239e-08 -2.209234933714637e-09 ] [ 7.74642462661751e-09 -8.162641754175162e-09 -1.72462601318022e-09 ] [ -2.71486441151395e-09 -5.807716494345475e-08 8.895312909142489e-08 ] [ 7.632514995843817e-09 6.012762016860655e-08 -8.221994611397426e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.96669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.276404446316115e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9528001 2.3232945 1.5073728 ] [ 1.1392822 1.6636108 3.931072 ] [ 1.6986141 4.2675007 3.4768731 ] [ 4.4301019 1.4946849 1.8917465 ] [ 3.6466082 2.4346407 4.2313911 ] [ 3.9695175 4.1509245 2.0695355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9528001e-10 2.3232945e-10 1.5073728e-10 ] [ 1.1392822e-10 1.6636108e-10 3.931072e-10 ] [ 1.6986141e-10 4.267500700000001e-10 3.4768731e-10 ] [ 4.430101900000001e-10 1.4946849e-10 1.8917465e-10 ] [ 3.6466082e-10 2.4346407e-10 4.2313911e-10 ] [ 3.9695175e-10 4.150924500000001e-10 2.0695355e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.3e-05 1.48e-05 1.04e-05 ] [ 4.39e-05 1.77e-05 1.32e-05 ] [ -4.73e-05 -1.27e-05 -1.9e-06 ] [ -3.53e-05 -1.16e-05 -1.49e-05 ] [ -2.39e-05 6.5e-06 -2.07e-05 ] [ 1.95e-05 -1.47e-05 1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.889359469439999e-14 2.371221398784e-14 1.666263685632e-14 ] [ 7.033555365312e-14 2.835852618816e-14 2.114873139456e-14 ] [ -7.578295416384e-14 -2.034764308416e-14 -3.04413557952e-15 ] [ -5.655683471424e-14 -1.858524880128e-14 -2.387243164992e-14 ] [ -3.829202123712e-14 1.04141480352e-14 -3.316505605055999e-14 ] [ 3.12424441056e-14 -2.355199632576e-14 2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.832972 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.337810068018102e-18 } }